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Details

Stereochemistry ACHIRAL
Molecular Formula C8H10N4O3
Molecular Weight 210.1903
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TRIMETHYLURIC ACID, 1,3,7-

SMILES

Cn1c2c(nc1O)n(C)c(=O)n(C)c2=O

InChI

InChIKey=BYXCFUMGEBZDDI-UHFFFAOYSA-N
InChI=1S/C8H10N4O3/c1-10-4-5(9-7(10)14)11(2)8(15)12(3)6(4)13/h1-3H3,(H,9,14)

HIDE SMILES / InChI

Molecular Formula C8H10N4O3
Molecular Weight 210.1903
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 15:15:14 UTC 2021
Edited
by admin
on Sat Jun 26 15:15:14 UTC 2021
Record UNII
Z61UN6MHB7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TRIMETHYLURIC ACID, 1,3,7-
Common Name English
HYDROXYCAFFEINE
Systematic Name English
NSC-95858
Code English
NSC-11259
Code English
J2.233K
Code English
1H-PURINE-2,6,8(3H)-TRIONE, 7,9-DIHYDRO-1,3,7-TRIMETHYL-
Systematic Name English
7,9-DIHYDRO-1,3,7-TRIMETHYL-1H-PURINE-2,6,8(3H)-TRIONE
Systematic Name English
8-OXOCAFFEINE
Systematic Name English
1,3,7-TRIMETHYLURIC ACID
Systematic Name English
1,3,7-TRIMETHYL-7,9-DIHYDRO-1H-PURINE-2,6,8(3H)-TRIONE
Systematic Name English
URIC ACID, 1,3,7-TRIMETHYL-
Systematic Name English
Code System Code Type Description
EPA CompTox
5415-44-1
Created by admin on Sat Jun 26 15:15:14 UTC 2021 , Edited by admin on Sat Jun 26 15:15:14 UTC 2021
PRIMARY
CAS
5415-44-1
Created by admin on Sat Jun 26 15:15:14 UTC 2021 , Edited by admin on Sat Jun 26 15:15:14 UTC 2021
PRIMARY
FDA UNII
Z61UN6MHB7
Created by admin on Sat Jun 26 15:15:14 UTC 2021 , Edited by admin on Sat Jun 26 15:15:14 UTC 2021
PRIMARY
WIKIPEDIA
1,3,7-Trimethyluric acid
Created by admin on Sat Jun 26 15:15:14 UTC 2021 , Edited by admin on Sat Jun 26 15:15:14 UTC 2021
PRIMARY
PUBCHEM
79437
Created by admin on Sat Jun 26 15:15:14 UTC 2021 , Edited by admin on Sat Jun 26 15:15:14 UTC 2021
PRIMARY
ECHA (EC/EINECS)
226-507-9
Created by admin on Sat Jun 26 15:15:14 UTC 2021 , Edited by admin on Sat Jun 26 15:15:14 UTC 2021
PRIMARY
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